SCHEMBL30140974

SCHEMBL30140974

COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(N)nc(F)nc43)C(O[Si](C)(C)C(C)(C)C)C2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 6/20 0.40
▸ ADORA1 P30542 5/20 0.35
▸ NT5E P21589 4/20 0.33
▸ ADORA2A P29274 5/20 0.33
▸ ADORA2B P29275 2/20 0.33
▸ CA5A P35218 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ ADORA3 P0DMS8 3/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30140968 0.98 TYMP (0.40) TYMPADORA1NT5EADORA2AADORA2B
SCHEMBL31359555 0.94 TYMP (0.42) TYMPADORA1NT5EADORA2AADORA2B
SCHEMBL30141033 0.91 TYMP (0.42) TYMPADORA1NT5E
SCHEMBL24191301 0.89 ADORA1 (0.43) TYMPADORA1NT5E
SCHEMBL20691389 0.87 TYMP (0.57) TYMPADORA1
SCHEMBL2365653 0.87 TYMP (0.42) TYMPADORA1NT5E
SCHEMBL30141043 0.86 TYMP (0.38) TYMPADORA1NT5EADORA2AADORA2B
SCHEMBL29827283 0.85 TYMP (0.39) TYMP
SCHEMBL16871812 0.85 TYMP (0.39) TYMPADORA1
SCHEMBL16871856 0.85 TYMP (0.39) TYMPADORA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250025564-A1 SIMPLE CHEMICAL APPROACHES TO INTRODUCE 2,6-DIAMINOPURINE AND 2-AMINOADENINE CONJUGATES INTO OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2025-01-23 — — US disclosed
EP-4370136-A2 SIMPLE CHEMICAL APPROACHES TO INTRODUCE 2,6-DIAMINOPURINE AND 2-AMINOADENINE CONJUGATES INTO OLIGONUCLEOTIDES Alnylam Pharmaceuticals, Inc. (US) 2024-05-22 — — EP disclosed
WO-2023288045-A2 SIMPLE CHEMICAL APPROACHES TO INTRODUCE 2,6-DIAMINOPURINE AND 2-AMINOADENINE CONJUGATES INTO OLIGONUCLEOTIDES ALNYLAM PHARMACEUTICALS, INC. (US) 2023-01-19 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250025564-A1 SIMPLE CHEMICAL APPROACHES TO INTRODUCE 2,6-DIAMINOPURINE AND 2-AMINOADENINE CONJUGATES INTO OLIGONUCLEOTIDES ADAR, ADA, NUDT1 TYMP 76/4885ADORA1 107/4885NT5E 56/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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